1-cyclopropyl-2-(2,4-difluorophenyl)ethanone

C11H10F2O — CID 23138773

IUPAC1-cyclopropyl-2-(2,4-difluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C11H10F2O/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7H,1-2,5H2
InChIKeyUKRZQYWMQREIPI-UHFFFAOYSA-N
MW196.20 g/mol
LogP2.49
Rot. Bonds3

About 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone

1-cyclopropyl-2-(2,4-difluorophenyl)ethanone (PubChem CID 23138773) has the molecular formula C11H10F2O and a molecular weight of 196.20 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone.

Molecular Properties

Compound Name1-cyclopropyl-2-(2,4-difluorophenyl)ethanone
PubChem CID23138773
Molecular FormulaC11H10F2O
Molecular Weight196.20 g/mol
Exact Mass196.07
IUPAC Name1-cyclopropyl-2-(2,4-difluorophenyl)ethanone
SMILESO=C(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C11H10F2O/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7H,1-2,5H2
InChIKeyUKRZQYWMQREIPI-UHFFFAOYSA-N
XLogP2.49
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.20
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4-difluorophenyl)-1-(3,4-dimethylcyclohexyl)ethanone
CID 64740615
1-cyclopropyl-2-(4-fluoro-2-methylphenyl)ethanone
CID 114347164
2-(2,4-difluorophenyl)-1-(9,9-dioxo-9λ6-thiabicyclo[3.3.1]nonan-3-yl)ethanone
CID 171947612
2-(2-chloro-5-fluorophenyl)-1-cyclopropylethanone
CID 102617613
1-cyclopropyl-4-(2,5-difluorophenyl)butan-1-one
CID 64502889
2-(2,4-difluorophenyl)-1-(3-ethylcyclohexyl)ethanone
CID 64560411
1-cyclopropyl-3-(2,5-difluorophenyl)propan-1-one
CID 63351882
2-(4-chloro-2-fluorophenyl)-1-cyclohexylethanone
CID 114853673
2-(4-chloro-2-fluorophenyl)-1-piperidin-4-ylethanone
CID 114863179
1-[4-(aminomethyl)cyclohexyl]-2-(4-bromo-2-fluorophenyl)ethanone
CID 116592499
2-(2-bromo-4-fluorophenyl)-1-(4-propan-2-ylcyclohexyl)ethanone
CID 65423303
2-(2,5-difluorophenyl)-1-(3-methylcyclopentyl)ethanone
CID 65402969

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone?
The IUPAC name of 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone (CID 23138773) is 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone.
What is the SMILES notation for 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone?
The canonical SMILES for 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone is O=C(Cc1ccc(F)cc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone?
The InChIKey is UKRZQYWMQREIPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F2O/c12-9-4-3-8(10(13)6-9)5-11(14)7-1-2-7/h3-4,6-7H,1-2,5H2.
What are the key properties of 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone?
1-cyclopropyl-2-(2,4-difluorophenyl)ethanone has a molecular weight of 196.20 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2,4-difluorophenyl)ethanone is sourced from PubChem (CID 23138773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).